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MolNFT v1 · #146617 · protein

Calmodulin-bound full-length RBTRPV5

6DMW · Transient receptor potential cation channel subfamily V…: “Calmodulin-bound full-length RBTRPV5”. Electron microscopy, 1 ligand (CA), 20 pockets (best druggability 0.86). MolNFT v1 #146617 on GenesisL1: 3D structure, binding sites…

PDB
6DMW
Type
protein
Length
2,562 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Transient receptor potential cation channel subfamily V member 5; Calmodulin-1
UniProt
Q9XSM3, P0DP29
Ligands
CA
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 5 distinct chains · 61% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATransient receptor potential cation channel subfamily V member 5protein63162% helix, 5% strandQ9XSM3
ECalmodulin-1protein11364% helix, 0% strandP0DP29
BTransient receptor potential cation channel subfamily V member 5protein60559% helix, 5% strandQ9XSM3
CTransient receptor potential cation channel subfamily V member 5protein60661% helix, 5% strandQ9XSM3
DTransient receptor potential cation channel subfamily V member 5protein60761% helix, 5% strandQ9XSM3

Ligands and binding sites

  • CA · Calcium ion · metal · 3 copies · chains E

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19180.860.8885empty
23100.850.9627empty
37460.840.8743empty
45500.840.8956empty
55070.830.8955empty

Interfaces

10 interfaces between chains.

  • C–D · 2984 Ų buried · 22 hydrogen bonds · protein-protein
  • A–B · 2979 Ų buried · 20 hydrogen bonds · protein-protein
  • A–C · 2969 Ų buried · 20 hydrogen bonds · protein-protein
  • B–D · 2914 Ų buried · 24 hydrogen bonds · protein-protein
  • A–E · 1933 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 6DMW · Calmodulin-bound full-length rbTRPV5 · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9XSM3 · AlphaFold monomer V2.0 prediction for transient receptor potential cation channel… · a predicted model of the same protein · chain D against A, TM-score 0.95
  • P0DP29 · AlphaFold monomer V2.0 prediction for calmodulin-1 (P0DP29) · a predicted model of the same protein · chain E against A, TM-score 0.55

Analyse

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